N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide

Systemtic Name: N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide Openeye Name: N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-1-(1-naphthylmethyl)piperidine-4-carboxamide CAS Name: N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-1-(1-naphthalenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide Traditional Name: N-(4-methoxy-3-piperidinosulfonyl-phenyl)-1-(1-naphthylmethyl)isonipecotamide Formula: C29H35N3O4S MolecularWeight: 521.6709

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)CC3=CC=CC4=CC=CC=C43)S(=O)(=O)N5CCCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)CC3=CC=CC4=CC=CC=C43)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C29H35N3O4S/c1-36-27-13-12-25(20-28(27)37(34,35)32-16-5-2-6-17-32)30-29(33)23-14-18-31(19-15-23)21-24-10-7-9-22-8-3-4-11-26(22)24/h3-4,7-13,20,23H,2,5-6,14-19,21H2,1H3,(H,30,33)